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CS-W001157 4
Total: USD 88.00

3,3,3-Trifluoro-2-hydroxypropanoic acid

  • CAS No. 684-07-1

  • Cat. No. CS-0112294
  • Purity≥97%
  • MDL No.MFCD00051802

*For research and further manufacturing use only, not for direct human use.

3,3,3-Trifluoro-2-hydroxypropanoic acid|CS-0112294

Structure of 684-07-1

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General Information

  • CAS No. 684-07-1
  • Cat. No. CS-0112294
  • Purity ≥97%
  • MDL No. MFCD00051802
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₃F₃O₃
  • Molecular Weight 144.05
  • Synonym(s) 3,3,3-Trifluorolactic acid
  • SMILES O=C(O)C(O)C(F)(F)F

Description

3,3,3-Trifluoro-2-hydroxypropanoic acid features a trifluoromethyl group flanking a hydroxylated carbon, delivering enhanced acidity and metabolic stability. This electron-withdrawing motif enables robust integration into bioactive scaffolds, particularly in kinase inhibitors and fluorinated metabolite analogs. The molecule exhibits excellent solubility in polar solvents and maintains stability under standard bench conditions, facilitating straightforward handling in synthetic workflows.

Synthesis

  • Route1
    • null|null
      126266-75-9
    • ~89%
    • In-stock
      3,3,3-Trifluoro-2-hydroxypropanoic acid|CS-0112294
      684-07-1

    References

    • Central Glass Company, Limited Patent: US2004/49076 A1, 2004 ; Location in patent: Page 5 ;
  • Route2
    • null|null
      13089-11-7
    • ~41%
    • In-stock
      3,3,3-Trifluoro-2-hydroxypropanoic acid|CS-0112294
      684-07-1

    References

    • Lermontov, Sergei A.; Shkavrov, Sergei V.; Kuryleva, Nina V. Journal of Fluorine Chemistry, 2003 , vol. 121, # 2 p. 223 - 225
  • Route3
    • Ethyl 3,3,3-trifluoro-DL-lactate|CS-0121308
      94726-00-8
    • ~80%
    • In-stock
      3,3,3-Trifluoro-2-hydroxypropanoic acid|CS-0112294
      684-07-1

    References

    • Bussche-Huennefeld, Christoph von .; Cescato, Claudio; Seebach, Dieter Chemische Berichte, 1992 , vol. 125, # 12 p. 2795 - 2802

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314-H335
Precautionary Statements : P260-P261-P264-P271-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   -0.0058
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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